Base information
| Cat. No. | |
| CAS No. | 858956-25-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2O3 |
| Molecular Weight | 180.161 |
| Exact Mass | 180.053 |
| XLogP3 | 0.3455 |
| Mr | 44.283 |
| PSA | 83.05 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(=O)[nH]c(n1)C1CC1 |
